4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,5-dimethoxyphenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,5-dimethoxyphenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,5-dimethoxyphenyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-(2,5-dimethoxyphenyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(2,5-dimethoxyphenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-(2,5-dimethoxyphenyl)butyramide Formula: C19H20N2O3S2 MolecularWeight: 388.5037

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H20N2O3S2/c1-23-13-9-10-16(24-2)15(12-13)20-18(22)8-5-11-25-19-21-14-6-3-4-7-17(14)26-19/h3-4,6-7,9-10,12H,5,8,11H2,1-2H3,(H,20,22)